SCHEMBL31489321

SCHEMBL31489321

Cc1ccc(C)n1-c1nc2c(F)cc(Br)cn2n1

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.40
CYP11B2 P19099 1/20 0.31
TP53 P04637 2/20 0.30
MAPT P10636 1/20 0.30
AHR P35869 2/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL31489562 0.79 KDM4E (0.37) KDM4E
SCHEMBL31489331 0.79 KDM4E (0.37) KDM4E
SCHEMBL19761009 0.78 MAPT (0.37) KDM4ECYP11B2TP53MAPTAHR
SCHEMBL31489290 0.74 LPL (0.34)
SCHEMBL31489938 0.74 PDE10A (0.41) KDM4EAHR
SCHEMBL31489696 0.73 KDM4E (0.37) KDM4ETP53MAPT
SCHEMBL31489379 0.73 KDM4E (0.37) KDM4EAHR
SCHEMBL16439335 0.71 PIK3CG (0.41) KDM4ECYP11B2MAPTAHR
SCHEMBL25104510 0.71 HSP90B1 (0.30) CYP11B2
SCHEMBL16439316 0.71 CYP11B2 (0.33) CYP11B2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025072395-A1 TRIAZOLOPYRIDINYL COMPOUNDS AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2025-04-03 WO disclosed